N-[5-(diethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)indole-2-carboxamide

Systemtic Name: N-[5-(diethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)indole-2-carboxamide Openeye Name: N-[5-(diethylaminomethyl)-3-pyridyl]-1-methyl-N-(N-oxocarbamimidoyl)indole-2-carboxamide CAS Name: N-[5-(diethylaminomethyl)-3-pyridinyl]-N-[imino(nitroso)methyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[5-(diethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxocarbamimidoyl)indole-2-carboxamide Traditional Name: N-[5-(diethylaminomethyl)-3-pyridyl]-N-(N-ketoamidino)-1-methyl-indole-2-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CN=C1)N(C(=O)C2=CC3=CC=CC=C3N2C)C(=N)N=O

Isomeric SMILES

CCN(CC)CC1=CC(=CN=C1)N(C(=O)C2=CC3=CC=CC=C3N2C)C(=N)N=O

InChI

InChI=1S/C21H24N6O2/c1-4-26(5-2)14-15-10-17(13-23-12-15)27(21(22)24-29)20(28)19-11-16-8-6-7-9-18(16)25(19)3/h6-13,22H,4-5,14H2,1-3H3